Home Halogens 4-bromo-6-(trifluoromethoxy)-1,3-benzothiazol-2-amine

4-bromo-6-(trifluoromethoxy)-1,3-benzothiazol-2-amine

CAS No.:
144631-82-3
Catalog Number:
AG01A1YI
Molecular Formula:
C8H4BrF3N2OS
Molecular Weight:
313.0944
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Product Description
Catalog Number:
AG01A1YI
Chemical Name:
4-bromo-6-(trifluoromethoxy)-1,3-benzothiazol-2-amine
CAS Number:
144631-82-3
Molecular Formula:
C8H4BrF3N2OS
Molecular Weight:
313.0944
MDL Number:
MFCD22565986
IUPAC Name:
4-bromo-6-(trifluoromethoxy)-1,3-benzothiazol-2-amine
InChI:
InChI=1S/C8H4BrF3N2OS/c9-4-1-3(15-8(10,11)12)2-5-6(4)14-7(13)16-5/h1-2H,(H2,13,14)
InChI Key:
UGMJJOPHHBHLNL-UHFFFAOYSA-N
SMILES:
Nc1nc2c(s1)cc(cc2Br)OC(F)(F)F
Properties
Complexity:
268  
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1  
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
311.918g/mol
Formal Charge:
0
Heavy Atom Count:
16  
Hydrogen Bond Acceptor Count:
7  
Hydrogen Bond Donor Count:
1  
Isotope Atom Count:
0
Molecular Weight:
313.092g/mol
Monoisotopic Mass:
311.918g/mol
Rotatable Bond Count:
1  
Topological Polar Surface Area:
76.4A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
XLogP3:
3.9  
Properties